4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide

C15H24N4O — CID 43517535

IUPAC4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide
SMILESNCCCN(c1ccnc(C(N)=O)c1)C1CCCCC1
InChIInChI=1S/C15H24N4O/c16-8-4-10-19(12-5-2-1-3-6-12)13-7-9-18-14(11-13)15(17)20/h7,9,11-12H,1-6,8,10,16H2,(H2,17,20)
InChIKeyILBZZMJBUQPRFV-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.67
Rot. Bonds6

About 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide

4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide (PubChem CID 43517535) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide
PubChem CID43517535
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide
SMILESNCCCN(c1ccnc(C(N)=O)c1)C1CCCCC1
InChIInChI=1S/C15H24N4O/c16-8-4-10-19(12-5-2-1-3-6-12)13-7-9-18-14(11-13)15(17)20/h7,9,11-12H,1-6,8,10,16H2,(H2,17,20)
InChIKeyILBZZMJBUQPRFV-UHFFFAOYSA-N
XLogP1.67
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide?
The IUPAC name of 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide (CID 43517535) is 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide is NCCCN(c1ccnc(C(N)=O)c1)C1CCCCC1.
What is the InChIKey of 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide?
The InChIKey is ILBZZMJBUQPRFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c16-8-4-10-19(12-5-2-1-3-6-12)13-7-9-18-14(11-13)15(17)20/h7,9,11-12H,1-6,8,10,16H2,(H2,17,20).
What are the key properties of 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide?
4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-aminopropyl(cyclohexyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 43517535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).